3-(4-tert-butylphenyl)-5-indol-1-yl-1-(phenylmethyl)indole-2-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-5-indol-1-yl-1-(phenylmethyl)indole-2-carboxylic acid Openeye Name: 1-benzyl-3-(4-tert-butylphenyl)-5-indol-1-yl-indole-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-5-(1-indolyl)-1-(phenylmethyl)-2-indolecarboxylic acid IUPAC Name: 1-benzyl-3-(4-tert-butylphenyl)-5-indol-1-ylindole-2-carboxylic acid Traditional Name: 1-benzyl-3-(4-tert-butylphenyl)-5-indol-1-yl-indole-2-carboxylic acid Formula: C34H30N2O2 MolecularWeight: 498.6142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)N4C=CC5=CC=CC=C54)CC6=CC=CC=C6)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)N4C=CC5=CC=CC=C54)CC6=CC=CC=C6)C(=O)O

InChI

InChI=1S/C34H30N2O2/c1-34(2,3)26-15-13-25(14-16-26)31-28-21-27(35-20-19-24-11-7-8-12-29(24)35)17-18-30(28)36(32(31)33(37)38)22-23-9-5-4-6-10-23/h4-21H,22H2,1-3H3,(H,37,38)